3,4,5-trimethoxy-N-[3-(2-oxochromen-3-yl)phenyl]benzamide

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Basic information

CAS: 5751-55-3
Standard SMILES: COc1cc(C(=O)Nc2cccc(-c3cc4ccccc4oc3=O)c2)cc(OC)c1OC
InChIKey: UQUDOGWGSXRGGB-UHFFFAOYSA-N
Molecular formula: C25H21NO6
Average molar mass: 431.4 g/mol
Monoisotopic mass: 431.13688739

Names & identifiers

Preferred name: 3,4,5-trimethoxy-N-[3-(2-oxochromen-3-yl)phenyl]benzamide
IUPAC: 3,4,5-trimethoxy-N-[3-(2-oxochromen-3-yl)phenyl]benzamide

Names & synonyms

3,4,5-trimethoxy-N-[3-(2-oxochromen-3-yl)phenyl]benzamide5751-55-33,4,5-trimethoxy-N-(3-(2-oxo-2H-chromen-3-yl)phenyl)benzamide3,4,5-trimethoxy-N-[3-(2-oxo-2H-chromen-3-yl)phenyl]benzamideCBMicro_032293MixCom6_001957Oprea1_418732DTXSID20360355STL511385AKOS000458050BIM-0032037.P001ST50239314

Show more names

SR-01000413950SR-01000413950-13,4,5-Trimethoxy-N-[3-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamideN-[3-(2-oxochromen-3-yl)phenyl](3,4,5-trimethoxyphenyl)carboxamide

Database identifiers

CAS: 5751-55-3
PubChem CID: 1104075
DTXSID: DTXSID20360355

Properties

Computed structural properties

XLogP: 4.3
Topological polar surface area: 83.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 6
Heavy atoms: 32
Formal charge: 0
Complexity: 695

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Compound notes

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